S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate
TL;DR: S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate (CAS 92924-90-8) is a chemical compound with molecular formula C15H23NOS and molecular weight 265.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-propan-2-yl N-methyl-N-(4-phenylbutyl)carbamothioate
Also Known As: S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate, S-(Propan-2-yl) methyl(4-phenylbutyl)carbamothioate, S-propan-2-yl N-methyl-N-(4-phenylbutyl)carbamothioate, N-methyl-N-(4-phenylbutyl)-1-propan-2-ylsulfanyl-formamide, Carbamothioic acid, methyl(4-phenylbutyl)-, S-(1-methylethyl) ester
| Molecular Formula | C15H23NOS |
|---|---|
| Molecular Weight | 265.15 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 265.15002 |
| Heavy Atoms | 18 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 92924-90-8 |
|---|---|
| SMILES | CC(C)SC(=O)N(C)CCCCC1=CC=CC=C1 |
| InChIKey | DQAWTFMZJWXKSI-UHFFFAOYSA-N |
Product Overview
S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate (CAS 92924-90-8), with molecular formula C15H23NOS and molecular weight 265.15 g/mol. IUPAC: S-propan-2-yl N-methyl-N-(4-phenylbutyl)carbamothioate.
Chemical Property Profile of S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate
Property Insights of S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate
The XLogP value of 4.1 indicates that S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.6 Ų, S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate?
The CAS number of S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate is 92924-90-8.
What is the molecular formula of S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate?
The molecular formula of S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate is C15H23NOS.
What is the molecular weight of S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate?
The molecular weight of S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate is 265.15 g/mol.
Where can I buy S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate?
You can request a quote for S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate?
Yes, KEHONG BIO provides custom synthesis services for S-Propan-2-yl methyl(4-phenylbutyl)carbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.